3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-(cyclohexylmethyl)-N-methyl-propanamide

Systemtic Name: 3-[3-butyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]-N-(cyclohexylmethyl)-N-methyl-propanamide Openeye Name: 3-(3-butyl-2,6-dioxo-7-pentyl-purin-8-yl)-N-(cyclohexylmethyl)-N-methyl-propanamide CAS Name: 3-(3-butyl-2,6-dioxo-7-pentyl-8-purinyl)-N-(cyclohexylmethyl)-N-methylpropanamide IUPAC Name: 3-(3-butyl-2,6-dioxo-7-pentylpurin-8-yl)-N-(cyclohexylmethyl)-N-methylpropanamide Traditional Name: 3-(7-amyl-3-butyl-2,6-diketo-purin-8-yl)-N-(cyclohexylmethyl)-N-methyl-propionamide Formula: C25H41N5O3 MolecularWeight: 459.62474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)N(C)CC3CCCCC3

Isomeric SMILES

CCCCCN1C(=NC2=C1C(=O)NC(=O)N2CCCC)CCC(=O)N(C)CC3CCCCC3

InChI

InChI=1S/C25H41N5O3/c1-4-6-11-17-29-20(14-15-21(31)28(3)18-19-12-9-8-10-13-19)26-23-22(29)24(32)27-25(33)30(23)16-7-5-2/h19H,4-18H2,1-3H3,(H,27,32,33)